2-(3,5-Diamino-1H-pyrazol-4-yl)-1-phenylethanone

CAS Registry Number®

105576-67-8
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CAS Name

2-(3,5-Diamino-1H-pyrazol-4-yl)-1-phenylethanone

Molecular Formula

C11H12N4O

Molecular Mass

216.24

Cite this Page

2-(3,5-Diamino-1H-pyrazol-4-yl)-1-phenylethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=105576-67-8 (retrieved 2024-09-14) (CAS RN: 105576-67-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    218-220 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C11H12N4O/c12-10-8(11(13)15-14-10)6-9(16)7-4-2-1-3-5-7/h1-5H,6H2,(H5,12,13,14,15)

InChIKey

InChIKey=MPULNORQAIXFGJ-UHFFFAOYSA-N

SMILES

C(C(=O)C1=CC=CC=C1)C=2C(N)=NNC2N

Canonical SMILES

O=C(C=1C=CC=CC1)CC=2C(=NNC2N)N

Other Names for this Substance

  • Ethanone, 2-(3,5-diamino-1H-pyrazol-4-yl)-1-phenyl-
  • 2-(3,5-Diamino-1H-pyrazol-4-yl)-1-phenylethanone
  • 2-(3,5-Diamino-1H-pyrazol-4-yl)-1-phenylethan-1-one